N-cyclohexyl-N-[2-[2-methoxyethyl-[[1-(phenylmethyl)pyrrol-2-yl]methyl]amino]-2-oxidanylidene-ethyl]-4-methyl-benzamide

Systemtic Name: N-cyclohexyl-N-[2-[2-methoxyethyl-[[1-(phenylmethyl)pyrrol-2-yl]methyl]amino]-2-oxidanylidene-ethyl]-4-methyl-benzamide Openeye Name: N-[2-[(1-benzylpyrrol-2-yl)methyl-(2-methoxyethyl)amino]-2-oxo-ethyl]-N-cyclohexyl-4-methyl-benzamide CAS Name: N-cyclohexyl-N-[2-[2-methoxyethyl-[[1-(phenylmethyl)-2-pyrrolyl]methyl]amino]-2-oxoethyl]-4-methylbenzamide IUPAC Name: N-[2-[(1-benzylpyrrol-2-yl)methyl-(2-methoxyethyl)amino]-2-oxoethyl]-N-cyclohexyl-4-methylbenzamide Traditional Name: N-[2-[(1-benzylpyrrol-2-yl)methyl-(2-methoxyethyl)amino]-2-keto-ethyl]-N-cyclohexyl-4-methyl-benzamide Formula: C31H39N3O3 MolecularWeight: 501.65966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(CC(=O)N(CCOC)CC2=CC=CN2CC3=CC=CC=C3)C4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(CC(=O)N(CCOC)CC2=CC=CN2CC3=CC=CC=C3)C4CCCCC4

InChI

InChI=1S/C31H39N3O3/c1-25-15-17-27(18-16-25)31(36)34(28-12-7-4-8-13-28)24-30(35)33(20-21-37-2)23-29-14-9-19-32(29)22-26-10-5-3-6-11-26/h3,5-6,9-11,14-19,28H,4,7-8,12-13,20-24H2,1-2H3